SCHEMBL10024252

SCHEMBL10024252

CC(=O)c1ccc(-c2ccc(C)c(C(=O)O)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MCL1 Q07820 3/20 0.53
HSD17B1 P14061 3/20 0.50
CFD P00746 1/20 0.46
RXRB P28702 3/20 0.46
RXRA P19793 2/20 0.46
KIF11 P52732 1/20 0.45
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
DHFR P00374 1/20 0.44
HNF4A P41235 1/20 0.44
ACMSD Q8TDX5 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GFER P55789 1/20 0.44
KMT2A Q03164 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RARB P10826 2/20 0.43
RARA P10276 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14866633 0.87 MCL1 (0.58) MCL1HSD17B1CFDRXRBRXRA
SCHEMBL70164 0.87 MCL1 (0.66) MCL1CFDRXRBRXRAAKR1C2
SCHEMBL12132604 0.85 AKR1C3 (0.54) AKR1C3AKR1C2ALDH1A1
SCHEMBL10024260 0.85 ACLY (0.49) MAPTSMN1; SMN2MCL1AKR1C3AKR1C2
Hydrochloric Acid SCHEMBL9153007 0.85 MCL1 (0.63) MCL1CFDRXRBRXRAAKR1C2
SCHEMBL9154339 0.83 MCL1 (0.62) MCL1CFDRXRBRXRADHFR
SCHEMBL10024279 0.83 MCL1 (0.63) MCL1AKR1C3AKR1C2DHFRHNF4A
SCHEMBL5255978 0.83 MCL1 (0.63) MCL1AKR1C3AKR1C2DHFRHNF4A
SCHEMBL27532814 0.83 RXRA (0.55) MAPTMCL1RXRBRXRAKDM4E
SCHEMBL4966627 0.83 MCL1 (0.70) SMN1; SMN2MCL1CFDRXRBRXRA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120083471-A1 Novel Compounds, Pharmaceutical Compositions Containing Same, Methods of Use for Same, and Methods for Preparing Same FAS SECURED CREDITORS HOLDCO, LLC 2012-04-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120083471-A1 Novel Compounds, Pharmaceutical Compositions Containing Same, Methods of Use for Same, and Methods for Preparing Same LCAT, DGAT2, SOAT2 MAPT 2464/4885SMN1; SMN2 3908/4885MCL1 4030/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.